CID 165952075

1-ethynyl-4,4-dimethylcyclohexan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H17N
SMILES
CC1(CCC(CC1)(C#C)N)C
InChI
InChI=1S/C10H17N/c1-4-10(11)7-5-9(2,3)6-8-10/h1H,5-8,11H2,2-3H3
InChIKey
GQKUOPJPPFFYSX-UHFFFAOYSA-N
Compound name
1-ethynyl-4,4-dimethylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.1361 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.143376 135.3
[M+Na]+ 174.125318 144.8
[M-H]- 150.128824 137.6
[M+NH4]+ 169.169923 157.6
[M+K]+ 190.099258 140.0
[M+H-H2O]+ 134.133360 125.9
[M+HCOO]- 196.134301 150.5
[M+CH3COO]- 210.149951 186.8
[M+Na-2H]- 172.110766 140.2
[M]+ 151.13555142 125.5
[M]- 151.13664858 125.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.